SCHEMBL4142375

SCHEMBL4142375

CC1(C)CCCC(C)(C)N1Cl

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34
CYP2C19 P33261 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15525247 0.97 TSHR (0.33) TSHRNFKB1CYP2C19
SCHEMBL21517924 0.97 TSHR (0.33) TSHRNFKB1CYP2C19
SCHEMBL28586980 0.97 TSHR (0.33) TSHRNFKB1CYP2C19
SCHEMBL28349565 0.94 TSHR (0.32) TSHRNFKB1CYP2C19
Methylamine SCHEMBL23410411 0.94 TSHR (0.32) TSHRNFKB1CYP2C19
Hydrochloric Acid SCHEMBL15569386 0.91 TSHR (0.31) TSHRNFKB1CYP2C19
Magnesium Chloride Anhydrous SCHEMBL28609893 0.89 TSHR (0.30) TSHRNFKB1CYP2C19
SCHEMBL16236606 0.83
Methacrylic Acid SCHEMBL28774452 0.78 TSHR (0.40) TSHRNFKB1CYP2C19
Acrylic Acid SCHEMBL27814354 0.78 TSHR (0.40) TSHRNFKB1CYP2C19

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 102 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240374773-A1 COMPOSITION FOR THE PREVENTION AND ELIMINATION OF ODORS OXISCIENCE, LLC (US) 2024-11-14 US claimed
US-12042581-B2 Method for manufacturing a medium for purifying fluids containing toxic compounds OXISCIENCE, LLC (US) 2024-07-23 US claimed
US-10765770-B2 Halogenated heterocyclic N-halamine coated garbage bags THE GLAD PRODUCTS COMPANY (US) 2020-09-08 US claimed
US-10721907-B2 Antimicrobial compositions and methods with novel polymeric binding system OXISCIENCE, LLC (US) 2020-07-28 US claimed
US-10568982-B2 Method of manufacturing particulate halogenated heterocyclic N-halamine compositions for the prevention and elimination of odors THE GLAD PRODUCTS COMPANY (US) 2020-02-25 US claimed
US-20190231915-A1 COMPOSITION FOR THE PREVENTION AND ELIMINATION OF ODORS OXISCIENCE, LLC (US) 2019-08-01 US claimed
US-20190231916-A1 COMPOSITION FOR THE PREVENTION AND ELIMINATION OF ODORS OXISCIENCE, LLC (US) 2019-08-01 US claimed
CN-108856249-A A kind of high-level cleaner and application method for rubbish deodorization and sterilization 南京海洛阿姆生物科技有限公司 2018-11-23 CN claimed
US-10028482-B2 Disinfecting and deodorizing compositions and methods with novel polymeric binding system OXISCIENCE LLC (US) 2018-07-24 US claimed
EP-3186333-A2 ANTIMICROBIAL COMPOSITIONS AND METHODS WITH NOVEL POLYMERIC BINDING SYSTEM Cao, Zhengbing (US) 2017-07-05 EP claimed
CN-106715647-A Antimicrobial formulations and methods with novel polymer loading systems 曹正兵 2017-05-24 CN claimed
US-20160058008-A1 ANTIMICROBIAL COMPOSITIONS AND METHODS WITH NOVEL POLYMERIC BINDING SYSTEM OXISCIENCE WA, LLC 2016-03-03 US claimed
WO-2016033340-A2 ANTIMICROBIAL COMPOSITIONS AND METHODS WITH NOVEL POLYMERIC BINDING SYSTEM CAO ZHENGBING (US) 2016-03-03 WO claimed
US-20090239907-A1 METHODS AND COMPOSITIONS FOR TREATING FISH DISEASES HALOSOURCE, INC. (US) 2009-09-24 US claimed
EP-1996187-A2 METHODS AND COMPOSITIONS FOR TREATING FISH DISEASES Halosource, Inc. (US) 2008-12-03 EP claimed
WO-2008115225-A2 METHODS AND COMPOSITIONS FOR TREATING FISH DISEASES HALOSOURCE, INC. (US) 2008-09-25 WO claimed
CN-1874959-A Method and article for maintaining hydantoinylated polymers in a biocidally active state VANSON HALOSOURCE INC (US) 2006-12-06 CN claimed
EP-1678078-A1 METHODS AND ARTICLES FOR MAINTAINING HYDANTOINYLATED POLYMERS IN A BIOCIDALLY ACTIVE STATE Vanson Halosource, Inc. (US) 2006-07-12 EP claimed
US-20050104034-A1 Methods and articles for maintaining hydantoinylated polymers in a biocidally active state VANSON HALOSOURCE, INC. (US) 2005-05-19 US claimed
WO-2005033004-A1 METHODS AND ARTICLES FOR MAINTAINING HYDANTOINYLATED POLYMERS IN A BIOCIDALLY ACTIVE STATE VANSON HALOSOURCE, INC. (US) 2005-04-14 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10765770-B2 Halogenated heterocyclic N-halamine coated garbage bags HEXB, CTSG, MAOB TSHR 836/4885NFKB1 2988/4885CYP2C19 394/4885
US-10028482-B2 Disinfecting and deodorizing compositions and methods with novel polymeric binding system LPO, CUTA, DDO TSHR 2366/4885NFKB1 1320/4885CYP2C19 2941/4885
US-20190231915-A1 COMPOSITION FOR THE PREVENTION AND ELIMINATION OF ODORS ABCB7, HEXB, MAOB TSHR 730/4885NFKB1 3106/4885CYP2C19 577/4885
US-20240374773-A1 COMPOSITION FOR THE PREVENTION AND ELIMINATION OF ODORS ABCB7, HEXB, MAOB TSHR 730/4885NFKB1 3106/4885CYP2C19 577/4885
US-20160058008-A1 ANTIMICROBIAL COMPOSITIONS AND METHODS WITH NOVEL POLYMERIC BINDING SYSTEM LPO, CUTA, MPO TSHR 3017/4885NFKB1 1347/4885CYP2C19 2649/4885
US-12042581-B2 Method for manufacturing a medium for purifying fluids containing toxic compounds NEFM, HTT, LPO TSHR 339/4885NFKB1 3441/4885CYP2C19 195/4885
US-10721907-B2 Antimicrobial compositions and methods with novel polymeric binding system LPO, CUTA, MPO TSHR 3017/4885NFKB1 1347/4885CYP2C19 2649/4885
US-20090239907-A1 METHODS AND COMPOSITIONS FOR TREATING FISH DISEASES AQP3, AQP1, NISCH TSHR 806/4885NFKB1 2336/4885CYP2C19 3170/4885
US-10568982-B2 Method of manufacturing particulate halogenated heterocyclic N-halamine compositions for the prevention and elimination of odors HEXB, MAOB, CTSG TSHR 508/4885NFKB1 3224/4885CYP2C19 413/4885
US-20190231916-A1 COMPOSITION FOR THE PREVENTION AND ELIMINATION OF ODORS ABCB7, HEXB, MAOB TSHR 730/4885NFKB1 3106/4885CYP2C19 577/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.